%chk=000291907.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291907

0 1
O 2.166473 1.727943 -0.094153
O 2.979947 0.179553 1.431053
O -1.042401 0.215769 -0.757530
N 2.828602 -0.422053 -0.866332
C 3.152186 0.687016 0.094089
C 1.622744 0.013733 -1.638389
C 1.067264 1.252459 -0.900648
C 2.620450 -1.653840 -0.041665
C 2.441443 -1.163912 1.407229
C 4.515015 1.320820 -0.012433
C -0.084434 0.938485 0.067746
C -2.229676 -0.177440 -0.176533
C -2.587459 0.035373 1.159200
C -3.078539 -0.847118 -1.082349
C -3.832085 -0.438476 1.592432
C -4.307672 -1.305849 -0.620447
C -4.688777 -1.105253 0.715459
H 0.858716 -0.781418 -1.751996
H 1.969122 0.280935 -2.660244
H 0.822979 2.096700 -1.576069
H 3.538296 -2.272785 -0.151281
H 1.771703 -2.268422 -0.393933
H 1.386511 -1.094809 1.722276
H 3.032899 -1.719359 2.150911
H 5.307492 0.581323 0.164857
H 4.669310 1.760439 -1.007268
H 4.625012 2.122071 0.733979
H -0.551267 1.857447 0.459579
H 0.244514 0.292950 0.902722
H -1.934665 0.554184 1.852180
H -2.763224 -0.986773 -2.112579
H -4.130071 -0.281041 2.629324
H -4.981356 -1.825048 -1.302453
H -5.652250 -1.468504 1.063169


%chk=000291907-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291907

0 1
O 2.122630 1.746454 -0.203657
O 3.053619 0.227633 1.507321
O -1.192183 0.212646 -0.884053
N 2.953966 -0.393117 -0.793865
C 3.173359 0.761981 0.111866
C 1.742373 -0.137420 -1.627557
C 1.042804 1.081684 -0.967204
C 3.032373 -1.636523 0.018746
C 2.625420 -1.187104 1.447504
C 4.508918 1.487962 0.029468
C -0.117609 0.735771 -0.024403
C -2.401478 -0.159147 -0.267827
C -2.643127 -0.076046 1.125885
C -3.405574 -0.642611 -1.143526
C -3.899429 -0.484923 1.633132
C -4.650682 -1.044972 -0.621712
C -4.906243 -0.969890 0.770343
H 1.076481 -1.018011 -1.656421
H 2.037307 0.106472 -2.663299
H 0.686923 1.807538 -1.717271
H 4.070313 -2.016494 0.015841
H 2.376277 -2.418130 -0.398850
H 1.532482 -1.271338 1.615142
H 3.158437 -1.726525 2.247548
H 5.332966 0.784935 0.232055
H 4.637093 1.925400 -0.973476
H 4.536500 2.294057 0.781284
H -0.451957 1.648334 0.505577
H 0.181259 -0.024468 0.723530
H -1.879383 0.300644 1.812714
H -3.190790 -0.690332 -2.215715
H -4.086161 -0.419838 2.711083
H -5.424667 -1.416469 -1.302625
H -5.875411 -1.283052 1.172328


